4-(5-bromanylthiophen-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-bromo-2-thienyl)-4-oxo-butanoic acid CAS Name: 4-(5-bromo-2-thiophenyl)-4-oxobutanoic acid IUPAC Name: 4-(5-bromothiophen-2-yl)-4-oxobutanoic acid Traditional Name: 4-(5-bromo-2-thienyl)-4-keto-butyric acid Formula: C8H7BrO3S MolecularWeight: 263.10838

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C(=O)CCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)Br)C(=O)CCC(=O)O

InChI

InChI=1S/C8H7BrO3S/c9-7-3-2-6(13-7)5(10)1-4-8(11)12/h2-3H,1,4H2,(H,11,12)